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SMILES: C[C@H](NS(=O)(=O)C(F)(F)F)c1ccc(cc1)S(=O)(=O)c1ccc(N)cc1S(=O)(=O)c1ccccc1F

InChI Key: InChIKey=PMIRIEIFLULQEW-ZDUSSCGKSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50211611   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50211611
PNG
((S)-N-(1-(4-(4-amino-2-(2-fluorophenylsulfonyl)phe...)
Show SMILES C[C@H](NS(=O)(=O)C(F)(F)F)c1ccc(cc1)S(=O)(=O)c1ccc(N)cc1S(=O)(=O)c1ccccc1F
Show InChI InChI=1S/C21H18F4N2O6S3/c1-13(27-36(32,33)21(23,24)25)14-6-9-16(10-7-14)34(28,29)19-11-8-15(26)12-20(19)35(30,31)18-5-3-2-4-17(18)22/h2-13,27H,26H2,1H3/t13-/m0/s1
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Article
PubMed
 10n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity to CB1 receptor

Bioorg Med Chem Lett 17: 3760-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.04.028
BindingDB Entry DOI: 10.7270/Q2HQ3ZKV
More data for this
Ligand-Target Pair